⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10789863 | 0.96 | — | — | |
| SCHEMBL9859678 | 0.96 | TDP1 (1.00) | — | |
| Water SCHEMBL11786429 | 0.96 | — | — | |
| SCHEMBL14868 | 0.96 | — | — | |
| SCHEMBL27779518 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL27378777 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL10535007 | 0.92 | — | — | |
| Ethylene SCHEMBL1897636 | 0.92 | — | — | |
| SCHEMBL9331295 | 0.92 | — | — | |
| SCHEMBL27766490 | 0.92 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0282351-B1 | Microbial cyanide converting enzymes, their production and use | NOVO NORDISK AS (DK) | 1993-12-15 | — | — | EP | disclosed |
| US-5116744-A | Cyanidase | NOVO INDUSTRI A/S (DK) | 1992-05-26 | — | — | US | disclosed |
| EP-0282351-A2 | Microbial cyanide converting enzymes, their production and use | NOVO NORDISK A/S (DK) | 1988-09-14 | — | — | EP | disclosed |